SCHEMBL4455699

SCHEMBL4455699

O=C(O)Nc1nc2ccc(C(=O)c3ccccc3)cc2[nH]1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 6/20 0.77
ALDH1A1 P00352 2/20 0.77
KDR P35968 2/20 0.77
ABCC4 O15439 1/20 0.77
USP2 O75604 1/20 0.77
LMNA P02545 1/20 0.77
CYP1A2 P05177 1/20 0.77
CYP2C9 P11712 1/20 0.77
HTT P42858 1/20 0.77
HIF1A Q16665 1/20 0.77
XIAP P98170 1/20 0.72
RAB9A P51151 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
POLB P06746 2/20 0.68
HPGD P15428 1/20 0.68
SCD O00767 1/20 0.65
FABP6 P51161 1/20 0.64
ADORA3 P0DMS8 1/20 0.60
PTGS1 P23219 1/20 0.60
MAPK1 P28482 1/20 0.60

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29388944 0.89 KDR (0.76) ABL1ALDH1A1KDRABCC4USP2
SCHEMBL11217960 0.89 KDR (0.76) ABL1ALDH1A1KDRABCC4USP2
SCHEMBL1678103 0.89 SCD (0.65) ABL1ALDH1A1KDRABCC4USP2
Mebendazole SCHEMBL536464 0.87 ABL1 (1.00) ABL1ALDH1A1KDRABCC4USP2
Mebendazole SCHEMBL29390263 0.87 ABL1 (1.00) ABL1ALDH1A1KDRABCC4USP2
SCHEMBL24209313 0.85 ABL1 (0.79) ABL1ALDH1A1KDRABCC4USP2
SCHEMBL14643048 0.85 ABL1 (1.00) ABL1ALDH1A1KDRABCC4USP2
SCHEMBL3031368 0.84 RAF1 (0.81) ABL1ALDH1A1KDRABCC4USP2
SCHEMBL14643046 0.84 ABL1 (1.00) ABL1ALDH1A1KDRABCC4USP2
SCHEMBL30804135 0.84 XIAP (1.00) ABL1ALDH1A1KDRABCC4USP2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11935803-B2 Resin composition, laminate, semiconductor wafer with resin composition layer, substrate for mounting semiconductor with resin composition layer and semiconductor device MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2024-03-19 US disclosed
WO-2024028599-A1 POLYMORPH OF THE KETOGLUTARATE OR P-TOLEUNESULPHONATE SALT OF MEBENDAZOLE HEALX LTD (GB) 2024-02-08 WO disclosed
US-20210277221-A1 RESIN COMPOSITION, LAMINATE, SEMICONDUCTOR WAFER WITH RESIN COMPOSITION LAYER, SUBSTRATE FOR MOUNTING SEMICONDUCTOR WITH RESIN COMPOSITION LAYER AND SEMICONDUCTOR DEVICE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-09-09 US disclosed
EP-3786200-A1 RESIN COMPOSITION, LAMINATE, RESIN COMPOSITION LAYER-ATTACHED SEMICONDUCTOR WAFER, SUBSTRATE FOR MOUNTING RESIN COMPOSITION LAYER-ATTACHED SEMICONDUCTOR, AND SEMICONDUCTOR DEVICE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-03-03 EP disclosed
EP-2133318-A1 Building board Nichiha Corporation (JP) 2009-12-16 EP disclosed
EP-0090368-A1 Anthelmintic preparations HOECHST UK LIMITED (GB) 1983-10-05 EP disclosed